Showing entry for 1,4-Dimethylbenzene


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0003474
Compound Name1,4-Dimethylbenzene
Structure
FormulaC8H10
InchiKeyURLKBWYHVLBVBO-UHFFFAOYSA-N
SMILESCC1=CC=C(C)C=C1
InchiInChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3
IUPAC1,4-xylene
Molecular Weight106.17
Pubchem Id7809
Chembl IdCHEMBL31561
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB PXY
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P00720 BXGT005625 Endolysin reviewed E - - - 422000 -
P00720 BXGT005625 Endolysin reviewed E - - - - -
P00720 BXGT005625 Endolysin reviewed E - - - - 6610
Binding DB 50008567
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE - 40 - -
reviewed BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE - 4900 - -
CHEMBL CHEMBL31561
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P00720 BXGT005625 Endolysin reviewed - E Kd - - -
P00720 BXGT005625 Endolysin reviewed - E Kd '=' 151000 nM
P00720 BXGT005625 Endolysin reviewed - E Kd '=' 422000 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 39810 nM
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE IC50 '=' 39 nM
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE IC50 '=' 4900 nM
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed Nuclear receptor PPARG Potency - 50118 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00016 Peanut Arachis hypogaea Nuts
BXGF00040 Pepper (C. annuum) Capsicum annuum Vegetables
BXGF00056 Mandarin orange (Clementine, Tangerine) Citrus reticulata Fruits
BXGF00093 Black walnut Juglans nigra Nuts
BXGF00131 Parsley Petroselinum crispum Herbs and Spices
BXGF00393 Pepper (C. frutescens) Capsicum annuum var. annuum Vegetables
BXGF00829 Green bell pepper Capsicum annuum Vegetables
BXGF00830 Yellow bell pepper Capsicum annuum Vegetables
BXGF00831 Orange bell pepper Capsicum annuum Vegetables
BXGF00832 Red bell pepper Capsicum annuum Vegetables
BXGF00946 Artemisia montana Artemisia montana Medicinal Plant
BXGF01065 Artemisia capillaris Artemisia capillaris Medicinal Plant
BXGF01140 Angelica gigas Angelica gigas Medicinal Plant
BXGF01721 Humulus lupulus Humulus lupulus Medicinal Plant
BXGF02049 Angelica sinensis Angelica sinensis Medicinal Plant
BXGF02131 Glycyrrhiza Glycyrrhiza Medicinal Plant
BXGF02425 Ephedra herba Ephedra herba Others
BXGF02635 Ephedra sinica Ephedra sinica Medicinal Plant
BXGF02852 Sophora flavescens Sophora flavescens Medicinal Plant
BXGF03277 Polygala sibirica Polygala sibirica Medicinal Plant
BXGF03714 Elsholtzia splendens Elsholtzia splendens Medicinal Plant
BXGF03953 Artemisia princeps Artemisia princeps Medicinal Plant
BXGF04209 Chaenomeles sinensis Chaenomeles sinensis Medicinal Plant
BXGF04400 Polygala tenuifolia Polygala tenuifolia Medicinal Plant
BXGF04611 Artemisia argyi Artemisia argyi Medicinal Plant
BXGF04842 Angelica acutiloba Angelica acutiloba Medicinal Plant
BXGF05511 Acorus gramineus Acorus gramineus Medicinal Plant
BXGF05852 Ixora chinensis Ixora chinensis Medicinal Plant
BXGF06071 Acorus tatarinowii Acorus tatarinowii Medicinal Plant
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease